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Theleganbanin B

CAT: 0013-GTR19255438-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255438-01Size:10 mg
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Description
Theleganbanin B is a p-terphenyl derivative discovered in the mushroom (Thelephora ganbajun) . It inhibits the production of TNF-α, IL-6, and IL-1β in BV-2 microglial cells induced by LPS. Theleganbanin B also suppresses the phosphorylation of JAK2/STAT3 and holds potential for neurodegenerative disease research.
CAS Number
31554-34-4
Smiles
O=C1OC2=C (C (=O) C (O) =C (C=3C=CC (O) =CC3) C2=C1C=4C=CC=CC4) C=5C=CC (O) =CC5
Molecular Formula
C26H16O6
Molecular Weight
424.40
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Hydroxy-4,7-bis(4-hydroxyphenyl)-3-phenyl-1-benzofuran-5,6-dione
CAS Number31554-34-4
PubChem CID176908601
IUPAC Name2-hydroxy-4,7-bis(4-hydroxyphenyl)-3-phenyl-1-benzofuran-5,6-dione
Molecular FormulaC26H16O6
Molecular Weight424.4
XLogP3.3
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count32
Formal Charge0
Complexity887
SMILES
C1=CC=C(C=C1)C2=C(OC3=C(C(=O)C(=O)C(=C23)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)O
InChI
InChI=1S/C26H16O6/c27-17-10-6-15(7-11-17)19-22-20(14-4-2-1-3-5-14)26(31)32-25(22)21(24(30)23(19)29)16-8-12-18(28)13-9-16/h1-13,27-28,31H
InChIKey
CWSHIWWOCHPXRC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Hydroxy-4,7-bis(4-hydroxyphenyl)-3-phenyl-1-benzofuran-5,6-dione
CAS: 31554-34-4
CID: 176908601
Formula: C26H16O6
MW: 424.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight424.4
XLogP33.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass424.09468823
Monoisotopic Mass424.09468823
Topological Polar Surface Area104 Ų
Heavy Atom Count32
Formal Charge0
Complexity887
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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